4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-1-(2-nitrophenyl)sulfonyl-pyrazole

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-1-(2-nitrophenyl)sulfonyl-pyrazole Openeye Name: 4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-1-(2-nitrophenyl)sulfonyl-pyrazole CAS Name: 4-[(4-chlorophenyl)thio]-3,5-dimethyl-1-(2-nitrophenyl)sulfonylpyrazole IUPAC Name: 4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-1-(2-nitrophenyl)sulfonylpyrazole Traditional Name: 4-[(4-chlorophenyl)thio]-3,5-dimethyl-1-(2-nitrophenyl)sulfonyl-pyrazole Formula: C17H14ClN3O4S2 MolecularWeight: 423.89376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3O4S2/c1-11-17(26-14-9-7-13(18)8-10-14)12(2)20(19-11)27(24,25)16-6-4-3-5-15(16)21(22)23/h3-10H,1-2H3